4-(1-Bromonaphthalen-2-yloxy)-2,7-dimethyl-5,6,7,8-tetrahydro-4H-furo[2,3-c]azepine

HCID 68412644
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Basic information

Standard SMILES
Cc1cc2c(o1)CN(C)CCC2Oc1ccc2ccccc2c1Br
InChIKey
ZCYJSIMLXSLARF-UHFFFAOYSA-N
Molecular formula
C20H20BrNO2
Average molar mass
386.3 g/mol
Monoisotopic mass
385.06774

Names & identifiers

Preferred name
4-(1-Bromonaphthalen-2-yloxy)-2,7-dimethyl-5,6,7,8-tetrahydro-4H-furo[2,3-c]azepine
IUPAC
4-(1-bromonaphthalen-2-yl)oxy-2,7-dimethyl-4,5,6,8-tetrahydrofuro[2,3-c]azepine

Names & synonyms

SCHEMBL2844309ZCYJSIMLXSLARF-UHFFFAOYSA-N4-(1-Bromonaphthalen-2-yloxy)-2,7-dimethyl-5,6,7,8-tetrahydro-4H-furo[2,3-c]azepine

Database identifiers

PubChem CID
68412644

Properties

Computed structural properties

XLogP
4.8
Topological polar surface area
25.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
24

Related reactions

2 records
New reaction record

Linked notes

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